==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 29-JUN-08 3DLT . COMPND 2 MOLECULE: ESTERASE D; . SOURCE 2 ORGANISM_SCIENTIFIC: LACTOBACILLUS RHAMNOSUS; . AUTHOR M.D.BENNETT,M.-L.DELABRE,R.HOLLAND,G.E.NORRIS . 239 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10126.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 171 71.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 27 11.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 2.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 7 2.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 30 12.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 90 37.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 0 1 0 1 1 0 0 0 1 1 0 2 0 0 0 0 0 0 0 1 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 2 1 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 3 A F 0 0 131 0, 0.0 2,-0.5 0, 0.0 53,-0.1 0.000 360.0 360.0 360.0 122.3 -8.7 -7.3 24.1 2 4 A R - 0 0 207 51,-0.1 50,-0.0 52,-0.0 0, 0.0 -0.830 360.0-128.4 -95.0 132.0 -5.7 -8.4 26.3 3 5 A K - 0 0 81 -2,-0.5 2,-0.4 1,-0.0 50,-0.1 -0.664 25.8-128.9 -74.6 115.3 -2.3 -6.9 25.7 4 6 A P - 0 0 15 0, 0.0 3,-0.1 0, 0.0 -1,-0.0 -0.538 27.3-156.5 -67.4 125.4 0.2 -9.8 25.4 5 7 A Q - 0 0 124 -2,-0.4 2,-0.1 1,-0.1 40,-0.0 -0.593 26.1 -92.7 -95.6 160.0 3.1 -9.1 27.7 6 8 A P - 0 0 53 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.421 50.7-164.0 -65.5 151.4 6.6 -10.5 27.4 7 9 A F E -A 45 0A 42 38,-1.8 38,-2.7 -3,-0.1 2,-0.3 -0.968 13.7-157.9-143.6 160.3 7.0 -13.7 29.3 8 10 A E E -A 44 0A 54 -2,-0.3 2,-0.4 36,-0.2 36,-0.2 -0.999 5.2-159.8-142.6 136.2 9.7 -16.0 30.7 9 11 A Y E -A 43 0A 31 34,-2.5 34,-2.0 -2,-0.3 2,-0.2 -0.960 26.2-126.5-111.7 134.8 10.1 -19.6 31.8 10 12 A E + 0 0 127 -2,-0.4 2,-0.2 32,-0.2 30,-0.1 -0.525 34.1 167.9 -77.5 145.1 12.9 -20.7 34.1 11 13 A G - 0 0 24 -2,-0.2 30,-0.2 1,-0.2 4,-0.1 -0.534 30.9-127.5-132.6-156.4 15.2 -23.5 33.1 12 14 A T S S+ 0 0 112 28,-0.7 72,-0.3 2,-0.3 -1,-0.2 0.583 86.5 1.6-124.8 -72.9 18.5 -24.9 34.3 13 15 A D S S+ 0 0 74 27,-0.3 72,-1.9 1,-0.2 71,-0.8 0.871 121.7 43.0 -90.7 -35.6 21.3 -25.4 31.7 14 16 A T E -b 85 0A 6 26,-0.3 28,-2.6 70,-0.2 -2,-0.3 -0.909 58.0-170.7-128.0 132.6 19.9 -24.1 28.4 15 17 A G E -bc 86 42A 0 70,-2.6 72,-2.1 -2,-0.4 2,-0.4 -0.890 7.3-154.1-120.2 156.8 17.8 -21.0 27.6 16 18 A V E -bc 87 43A 0 26,-1.6 28,-2.0 -2,-0.3 2,-0.5 -0.998 3.9-154.3-138.0 127.5 16.0 -20.0 24.4 17 19 A V E -bc 88 44A 0 70,-2.4 72,-2.5 -2,-0.4 2,-0.5 -0.905 12.2-166.7 -97.9 130.3 15.1 -16.5 23.0 18 20 A L E -b 89 0A 0 26,-2.0 2,-0.5 -2,-0.5 72,-0.2 -0.991 3.5-159.6-123.1 120.9 12.1 -16.5 20.7 19 21 A L E -b 90 0A 1 70,-2.3 72,-1.7 -2,-0.5 75,-0.2 -0.903 19.2-131.9-110.1 127.0 11.5 -13.3 18.7 20 22 A H - 0 0 0 -2,-0.5 74,-1.4 26,-0.4 2,-0.1 0.147 21.3 -84.1 -84.3-175.9 8.0 -12.8 17.3 21 23 A A > - 0 0 10 4,-0.4 3,-1.7 72,-0.2 2,-0.3 -0.391 47.1 -91.5 -83.0 159.4 6.5 -11.8 13.9 22 24 A Y T 3 S+ 0 0 22 1,-0.3 -1,-0.1 -2,-0.1 3,-0.1 -0.577 121.3 12.1 -65.6 130.2 5.9 -8.3 12.4 23 25 A T T 3 S+ 0 0 32 -2,-0.3 -1,-0.3 1,-0.2 29,-0.1 0.421 118.9 103.4 67.8 3.0 2.4 -7.4 13.5 24 26 A G < - 0 0 12 -3,-1.7 28,-0.5 27,-0.1 -1,-0.2 0.011 55.1-158.5 -90.0-157.7 2.6 -10.3 15.9 25 27 A S > - 0 0 13 26,-0.1 3,-1.9 -3,-0.1 -4,-0.4 -0.914 49.0 -66.9-164.5 179.5 3.3 -10.5 19.6 26 28 A P G > S+ 0 0 1 0, 0.0 3,-1.9 0, 0.0 4,-0.2 0.755 120.6 77.8 -51.9 -23.9 4.5 -13.0 22.2 27 29 A N G > S+ 0 0 82 1,-0.3 3,-1.5 2,-0.2 4,-0.4 0.841 80.5 68.2 -55.4 -30.2 1.3 -15.0 21.4 28 30 A D G < S+ 0 0 24 -3,-1.9 -1,-0.3 1,-0.3 4,-0.3 0.758 105.3 42.4 -53.9 -27.1 3.1 -16.2 18.3 29 31 A M G <> S+ 0 0 0 -3,-1.9 4,-3.1 -4,-0.3 5,-0.3 0.300 80.9 104.1-109.3 6.9 5.4 -18.2 20.5 30 32 A N H <> S+ 0 0 60 -3,-1.5 4,-1.9 -4,-0.2 5,-0.2 0.909 86.3 40.6 -62.3 -46.3 3.0 -19.6 23.1 31 33 A F H > S+ 0 0 89 -4,-0.4 4,-2.1 189,-0.2 -1,-0.2 0.946 119.4 45.5 -69.7 -47.2 3.0 -23.2 21.8 32 34 A M H > S+ 0 0 0 188,-0.3 4,-2.4 -4,-0.3 5,-0.2 0.909 111.3 51.9 -60.2 -52.1 6.7 -23.3 21.0 33 35 A A H X S+ 0 0 0 -4,-3.1 4,-2.4 1,-0.2 -1,-0.2 0.935 113.3 45.6 -45.8 -52.2 7.7 -21.7 24.4 34 36 A R H X S+ 0 0 125 -4,-1.9 4,-2.5 -5,-0.3 -2,-0.2 0.874 109.5 54.3 -64.1 -37.8 5.6 -24.3 26.2 35 37 A A H X S+ 0 0 1 -4,-2.1 4,-1.1 1,-0.2 -1,-0.2 0.918 111.0 46.3 -62.9 -41.8 7.0 -27.2 24.1 36 38 A L H <>S+ 0 0 0 -4,-2.4 5,-2.6 2,-0.2 -2,-0.2 0.869 110.4 53.5 -68.1 -37.7 10.5 -26.1 25.0 37 39 A Q H ><5S+ 0 0 69 -4,-2.4 3,-2.1 1,-0.2 -2,-0.2 0.917 103.6 55.9 -61.6 -43.4 9.5 -25.8 28.7 38 40 A R H 3<5S+ 0 0 176 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.815 106.8 51.7 -60.4 -27.7 8.1 -29.4 28.6 39 41 A S T 3<5S- 0 0 58 -4,-1.1 -1,-0.3 -5,-0.2 -2,-0.2 0.269 127.5 -99.2 -93.9 16.0 11.6 -30.4 27.5 40 42 A G T < 5S+ 0 0 42 -3,-2.1 -28,-0.7 1,-0.3 -26,-0.3 0.560 75.7 140.7 86.7 12.4 13.3 -28.6 30.4 41 43 A Y < - 0 0 25 -5,-2.6 2,-0.3 -30,-0.2 -1,-0.3 -0.562 50.7-127.1 -90.5 146.7 14.3 -25.4 28.6 42 44 A G E - c 0 15A 0 -28,-2.6 -26,-1.6 -2,-0.2 2,-0.3 -0.669 32.3-165.5 -79.7 148.9 14.3 -21.8 29.8 43 45 A V E -Ac 9 16A 0 -34,-2.0 -34,-2.5 -2,-0.3 2,-0.3 -0.990 17.4-172.4-141.9 141.1 12.4 -19.5 27.5 44 46 A Y E -Ac 8 17A 49 -28,-2.0 -26,-2.0 -2,-0.3 -36,-0.2 -0.946 2.4-178.4-139.0 126.4 12.1 -15.7 27.0 45 47 A V E -A 7 0A 0 -38,-2.7 -38,-1.8 -2,-0.3 -26,-0.1 -0.913 14.6-167.5-127.6 92.6 9.7 -14.1 24.6 46 48 A P - 0 0 8 0, 0.0 2,-0.5 0, 0.0 -26,-0.4 -0.369 20.0-117.0 -78.2 170.3 9.9 -10.3 24.6 47 49 A L - 0 0 45 -2,-0.1 2,-0.2 -28,-0.1 3,-0.1 -0.905 23.0-134.1-108.9 127.0 7.5 -7.8 23.1 48 50 A F > - 0 0 1 -2,-0.5 3,-1.6 1,-0.1 20,-0.1 -0.603 37.6 -90.0 -80.0 144.4 8.7 -5.6 20.3 49 51 A S T 3 S+ 0 0 38 1,-0.2 14,-0.1 -2,-0.2 -1,-0.1 -0.162 110.4 20.0 -52.2 144.5 7.9 -1.8 20.5 50 52 A G T 3 S+ 0 0 13 1,-0.3 9,-0.3 12,-0.2 3,-0.3 0.194 105.6 105.7 78.1 -15.3 4.6 -0.7 18.9 51 53 A H < + 0 0 5 -3,-1.6 -1,-0.3 1,-0.2 -26,-0.1 -0.511 56.8 40.3 -93.6 163.7 3.3 -4.2 19.0 52 54 A G S S+ 0 0 7 -28,-0.5 2,-0.3 1,-0.3 -1,-0.2 0.685 86.4 111.3 78.4 20.8 0.7 -5.9 21.3 53 55 A T S S- 0 0 38 -3,-0.3 -1,-0.3 2,-0.1 6,-0.1 -0.792 78.1-114.0-123.3 166.3 -1.8 -3.0 21.4 54 56 A V S S+ 0 0 62 -2,-0.3 86,-0.2 1,-0.1 -1,-0.0 0.641 99.2 77.6 -72.0 -13.2 -5.3 -2.5 20.1 55 57 A E > - 0 0 55 1,-0.1 3,-2.0 -5,-0.1 4,-0.4 -0.851 62.8-164.0-107.1 103.3 -4.0 0.3 17.8 56 58 A P T >> S+ 0 0 0 0, 0.0 3,-1.0 0, 0.0 4,-0.7 0.758 85.9 68.5 -53.2 -31.7 -2.2 -1.0 14.6 57 59 A L H 3> S+ 0 0 16 1,-0.2 4,-2.0 2,-0.2 5,-0.3 0.707 83.5 73.3 -64.1 -19.1 -0.6 2.4 13.9 58 60 A D H <>>S+ 0 0 21 -3,-2.0 4,-3.1 1,-0.2 5,-0.7 0.873 91.2 56.8 -61.0 -38.4 1.5 2.0 17.1 59 61 A I H <>5S+ 0 0 2 -3,-1.0 4,-0.8 -4,-0.4 -1,-0.2 0.918 113.4 40.2 -54.6 -44.9 3.6 -0.6 15.2 60 62 A L H <5S+ 0 0 11 -4,-0.7 -2,-0.2 -10,-0.2 -1,-0.2 0.747 126.9 31.4 -78.3 -30.9 4.3 2.0 12.5 61 63 A T H <5S+ 0 0 71 -4,-2.0 -3,-0.2 -11,-0.1 -2,-0.2 0.700 126.3 36.2-104.7 -25.0 4.8 5.1 14.8 62 64 A K H <5S+ 0 0 125 -4,-3.1 2,-0.3 -5,-0.3 -12,-0.2 0.573 112.4 53.6-109.2 -12.6 6.3 3.6 18.0 63 65 A G << + 0 0 4 -4,-0.8 -13,-0.1 -5,-0.7 -15,-0.0 -0.877 52.0 164.0-119.5 159.2 8.5 0.8 16.6 64 66 A N >> - 0 0 60 -2,-0.3 4,-2.4 95,-0.0 3,-0.8 -0.958 50.6 -95.6-160.6 161.4 11.3 0.6 14.1 65 67 A P H 3> S+ 0 0 6 0, 0.0 4,-2.2 0, 0.0 5,-0.1 0.753 120.7 53.5 -52.2 -32.7 14.1 -1.9 13.2 66 68 A D H 3> S+ 0 0 113 2,-0.2 4,-1.8 1,-0.2 5,-0.1 0.867 111.8 45.4 -74.1 -35.0 16.7 -0.2 15.3 67 69 A I H <> S+ 0 0 56 -3,-0.8 4,-2.1 2,-0.2 -1,-0.2 0.920 113.9 49.4 -67.7 -44.4 14.5 -0.3 18.4 68 70 A W H X S+ 0 0 0 -4,-2.4 4,-1.9 1,-0.2 -2,-0.2 0.854 110.3 50.5 -70.7 -33.7 13.6 -3.9 17.7 69 71 A W H X S+ 0 0 47 -4,-2.2 4,-2.9 -5,-0.2 -1,-0.2 0.916 109.5 50.2 -65.8 -44.1 17.2 -4.9 17.2 70 72 A A H X S+ 0 0 57 -4,-1.8 4,-2.1 1,-0.2 -2,-0.2 0.885 113.7 46.9 -56.2 -40.0 18.2 -3.2 20.6 71 73 A E H X S+ 0 0 54 -4,-2.1 4,-1.8 2,-0.2 -1,-0.2 0.855 112.5 48.8 -72.8 -35.7 15.3 -5.1 22.2 72 74 A S H X S+ 0 0 2 -4,-1.9 4,-1.9 2,-0.2 -2,-0.2 0.901 112.4 49.2 -68.8 -42.6 16.4 -8.4 20.5 73 75 A S H X S+ 0 0 37 -4,-2.9 4,-1.9 1,-0.2 -2,-0.2 0.901 110.6 49.1 -64.8 -40.6 19.9 -7.8 21.6 74 76 A A H X S+ 0 0 61 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.850 108.5 54.5 -68.4 -35.7 18.9 -7.0 25.2 75 77 A A H X S+ 0 0 2 -4,-1.8 4,-1.3 2,-0.2 -1,-0.2 0.862 108.0 49.2 -65.8 -38.8 16.7 -10.2 25.3 76 78 A V H X S+ 0 0 5 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.921 110.7 50.1 -64.5 -45.6 19.8 -12.3 24.3 77 79 A A H X S+ 0 0 54 -4,-1.9 4,-1.0 1,-0.2 -2,-0.2 0.849 105.2 58.3 -60.5 -37.8 21.9 -10.6 27.0 78 80 A H H < S+ 0 0 72 -4,-2.0 4,-0.3 1,-0.2 -1,-0.2 0.897 114.2 37.7 -57.4 -40.2 19.1 -11.4 29.6 79 81 A M H >X S+ 0 0 0 -4,-1.3 4,-2.1 -3,-0.2 3,-1.1 0.856 110.1 56.8 -87.1 -33.3 19.4 -15.1 28.8 80 82 A T H 3< S+ 0 0 53 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.611 100.7 62.1 -75.3 -12.0 23.2 -15.4 28.3 81 83 A A T 3< S+ 0 0 88 -4,-1.0 -1,-0.2 -5,-0.2 -2,-0.2 0.697 116.7 29.1 -73.3 -20.6 23.6 -13.9 31.9 82 84 A K T <4 S+ 0 0 84 -3,-1.1 2,-0.3 -4,-0.3 -2,-0.2 0.756 109.2 59.2-112.0 -39.5 21.8 -17.0 33.3 83 85 A Y < - 0 0 17 -4,-2.1 -69,-0.2 1,-0.1 -70,-0.2 -0.840 64.9-136.1-110.9 146.6 22.2 -20.1 31.2 84 86 A A S S+ 0 0 85 -71,-0.8 2,-0.4 -2,-0.3 -70,-0.2 0.861 97.9 27.5 -60.4 -40.0 25.2 -22.1 30.1 85 87 A K E S-b 14 0A 87 -72,-1.9 -70,-2.6 -6,-0.1 2,-0.4 -0.974 70.5-168.3-130.1 136.9 23.9 -22.4 26.6 86 88 A V E -b 15 0A 1 21,-0.4 23,-2.5 -2,-0.4 24,-1.0 -0.997 2.3-166.8-129.7 135.4 21.5 -20.0 24.7 87 89 A F E -bd 16 110A 5 -72,-2.1 -70,-2.4 -2,-0.4 2,-0.4 -0.837 7.9-156.7-113.9 151.9 19.6 -20.5 21.4 88 90 A V E +bd 17 111A 0 22,-1.1 24,-2.0 -2,-0.3 2,-0.3 -0.961 18.9 161.6-139.7 115.9 17.9 -17.7 19.4 89 91 A F E +bd 18 112A 0 -72,-2.5 -70,-2.3 -2,-0.4 2,-0.3 -0.888 5.7 171.1-127.4 161.9 15.0 -18.2 16.9 90 92 A G E -bd 19 113A 0 22,-0.9 24,-2.6 -2,-0.3 25,-0.5 -0.980 32.5-109.4-160.9 168.9 12.4 -16.0 15.4 91 93 A L S > S- 0 0 0 -72,-1.7 4,-1.5 -2,-0.3 24,-0.5 0.334 73.8 -57.8 -79.5-145.9 9.7 -15.7 12.7 92 94 A S H > S+ 0 0 6 2,-0.2 4,-1.1 22,-0.2 26,-0.3 0.997 140.0 27.2 -68.7 -60.4 10.4 -13.5 9.7 93 95 A L H >> S+ 0 0 0 1,-0.2 4,-1.4 2,-0.2 3,-1.4 0.980 126.4 46.7 -57.6 -62.7 11.0 -10.2 11.5 94 96 A G H 3> S+ 0 0 0 -74,-1.4 4,-2.2 1,-0.3 -1,-0.2 0.846 108.5 59.9 -48.6 -36.3 12.2 -11.8 14.7 95 97 A G H 3X S+ 0 0 2 -4,-1.5 4,-2.2 2,-0.2 -1,-0.3 0.763 96.2 58.5 -71.2 -26.4 14.4 -14.1 12.5 96 98 A I H < - 0 0 35 -4,-2.6 3,-0.5 -5,-0.3 2,-0.1 -0.777 68.5-120.9-107.7 144.7 26.6 -11.1 19.3 106 108 A P T 3 S+ 0 0 107 0, 0.0 -26,-0.1 0, 0.0 -2,-0.1 -0.401 80.7 23.8 -77.1 150.4 28.7 -13.0 21.7 107 109 A G T 3 S+ 0 0 62 1,-0.2 2,-0.5 -2,-0.1 -21,-0.4 0.534 73.1 136.3 85.7 12.9 27.8 -16.3 23.5 108 110 A I < - 0 0 11 -3,-0.5 -1,-0.2 -7,-0.2 -21,-0.2 -0.816 35.8-164.1-100.9 131.1 25.1 -17.8 21.4 109 111 A T - 0 0 48 -23,-2.5 2,-0.3 -2,-0.5 -22,-0.2 0.901 66.2 -32.5 -80.5 -45.8 25.3 -21.6 20.7 110 112 A A E +d 87 0A 0 -24,-1.0 -22,-1.1 66,-0.2 -1,-0.3 -0.955 62.1 158.5-165.0 176.8 22.9 -21.8 17.8 111 113 A G E +de 88 178A 0 66,-1.2 68,-2.7 -2,-0.3 2,-0.3 -0.942 3.3 165.3-179.3-168.2 19.8 -20.3 16.4 112 114 A G E -de 89 179A 0 -24,-2.0 -22,-0.9 -2,-0.3 2,-0.3 -0.994 33.0 -70.3 160.0-156.3 17.8 -19.8 13.2 113 115 A V E -de 90 180A 5 66,-2.3 68,-1.6 -2,-0.3 -22,-0.2 -0.898 5.2-156.1-137.0 149.5 14.5 -18.8 11.7 114 116 A F S S+ 0 0 0 -24,-2.6 105,-0.3 -2,-0.3 2,-0.3 0.304 89.1 19.6-106.1 0.0 10.9 -20.2 11.4 115 117 A S S S- 0 0 1 -25,-0.5 -1,-0.3 -24,-0.5 67,-0.1 -0.967 92.3 -83.8-163.4 161.7 10.3 -18.2 8.3 116 118 A S - 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0 0 0 -3,-1.4 -30,-2.6 -33,-0.1 -3,-0.1 -0.617 57.3-134.4 -93.4 140.9 1.3 -24.9 6.2 216 218 A K - 0 0 92 -2,-0.3 -30,-0.3 -32,-0.2 8,-0.1 -0.134 48.6 -74.0 -74.8-177.9 0.6 -21.2 5.9 217 219 A H S S+ 0 0 18 -32,-0.4 2,-2.0 1,-0.2 -34,-0.3 0.818 115.3 65.5 -49.7 -51.3 3.1 -18.6 7.2 218 220 A V >> + 0 0 45 1,-0.2 4,-1.8 2,-0.1 3,-1.8 -0.494 56.2 166.6 -88.6 77.7 2.8 -18.8 11.1 219 221 A I T 34 + 0 0 0 -2,-2.0 9,-0.3 -105,-0.3 -1,-0.2 0.619 67.8 67.2 -73.4 -12.4 4.1 -22.3 11.6 220 222 A T T 34 S+ 0 0 0 1,-0.1 -188,-0.3 -3,-0.1 -1,-0.3 0.651 117.3 24.1 -73.5 -16.9 4.6 -21.7 15.3 221 223 A V T <4 S+ 0 0 63 -3,-1.8 -2,-0.2 -190,-0.1 -1,-0.1 0.586 113.1 68.2-124.5 -26.1 0.8 -21.5 15.7 222 224 A N S >< S- 0 0 37 -4,-1.8 3,-2.6 -6,-0.1 4,-0.3 -0.041 105.4 -59.6 -96.3-161.9 -0.8 -23.4 12.8 223 225 A S T 3 S+ 0 0 91 1,-0.3 3,-0.4 2,-0.1 4,-0.3 0.714 129.3 57.0 -56.6 -26.6 -1.1 -27.0 11.6 224 226 A A T 3> S+ 0 0 8 1,-0.2 4,-2.8 -8,-0.1 -1,-0.3 0.473 77.1 97.4 -81.5 -4.5 2.7 -27.4 11.4 225 227 A H H <> S+ 0 0 32 -3,-2.6 4,-2.6 1,-0.2 5,-0.2 0.857 80.4 51.3 -65.8 -35.7 3.5 -26.4 15.0 226 228 A H H > S+ 0 0 127 -3,-0.4 4,-2.1 -4,-0.3 -1,-0.2 0.932 114.3 44.0 -61.1 -47.1 3.8 -29.9 16.4 227 229 A A H > S+ 0 0 38 -4,-0.3 4,-2.7 1,-0.2 5,-0.2 0.946 113.2 52.5 -62.6 -47.3 6.3 -30.9 13.6 228 230 A L H X S+ 0 0 0 -4,-2.8 4,-2.6 -9,-0.3 5,-0.2 0.900 109.4 48.7 -54.5 -44.0 8.1 -27.6 14.1 229 231 A E H X S+ 0 0 10 -4,-2.6 4,-2.1 2,-0.2 -1,-0.2 0.907 111.6 49.4 -65.8 -40.5 8.5 -28.2 17.9 230 232 A E H X S+ 0 0 135 -4,-2.1 4,-2.6 -5,-0.2 -2,-0.2 0.957 114.1 45.1 -62.7 -48.7 9.8 -31.7 17.3 231 233 A D H X S+ 0 0 31 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.821 113.9 48.3 -65.8 -39.4 12.3 -30.5 14.7 232 234 A V H X S+ 0 0 0 -4,-2.6 4,-2.2 -5,-0.2 -1,-0.2 0.891 112.6 48.6 -69.5 -39.1 13.5 -27.5 16.8 233 235 A I H X S+ 0 0 24 -4,-2.1 4,-2.8 -5,-0.2 5,-0.2 0.963 111.7 49.6 -65.1 -47.6 13.9 -29.7 19.9 234 236 A A H X S+ 0 0 36 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.894 111.0 50.8 -57.7 -44.5 15.8 -32.4 17.9 235 237 A F H X S+ 0 0 0 -4,-2.0 4,-0.8 2,-0.2 -1,-0.2 0.903 110.7 47.9 -56.1 -47.3 18.1 -29.6 16.5 236 238 A M H >< S+ 0 0 4 -4,-2.2 3,-0.8 1,-0.2 -2,-0.2 0.906 112.6 49.1 -62.7 -42.0 18.8 -28.2 20.0 237 239 A Q H 3< S+ 0 0 108 -4,-2.8 -2,-0.2 2,-0.3 -1,-0.2 0.867 99.8 65.0 -64.6 -37.2 19.5 -31.7 21.3 238 240 A Q H 3< 0 0 114 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.767 360.0 360.0 -57.9 -25.9 21.9 -32.3 18.3 239 241 A E << 0 0 79 -4,-0.8 -1,-0.3 -3,-0.8 -2,-0.3 0.471 360.0 360.0-109.5 360.0 23.9 -29.6 19.9